(3-amino-7-methylthieno[2,3-b]quinolin-2-yl)-(2-methyl-2,3-dihydroindol-1-yl)methanone

C22H19N3OS — CID 3207319

IUPAC(3-amino-7-methylthieno[2,3-b]quinolin-2-yl)-(2-methyl-2,3-dihydroindol-1-yl)methanone
SMILESCc1ccc2cc3c(N)c(C(=O)N4c5ccccc5CC4C)sc3nc2c1
InChIInChI=1S/C22H19N3OS/c1-12-7-8-14-11-16-19(23)20(27-21(16)24-17(14)9-12)22(26)25-13(2)10-15-5-3-4-6-18(15)25/h3-9,11,13H,10,23H2,1-2H3
InChIKeyLIMHQWLVCZLYRD-UHFFFAOYSA-N
MW373.48 g/mol
LogP4.93
Rot. Bonds1

About (3-amino-7-methylthieno[2,3-b]quinolin-2-yl)-(2-methyl-2,3-dihydroindol-1-yl)methanone

(3-amino-7-methylthieno[2,3-b]quinolin-2-yl)-(2-methyl-2,3-dihydroindol-1-yl)methanone (PubChem CID 3207319) has the molecular formula C22H19N3OS and a molecular weight of 373.48 g/mol. Its IUPAC name is (3-amino-7-methylthieno[2,3-b]quinolin-2-yl)-(2-methyl-2,3-dihydroindol-1-yl)methanone.

Molecular Properties

Compound Name(3-amino-7-methylthieno[2,3-b]quinolin-2-yl)-(2-methyl-2,3-dihydroindol-1-yl)methanone
PubChem CID3207319
Molecular FormulaC22H19N3OS
Molecular Weight373.48 g/mol
Exact Mass373.12
IUPAC Name(3-amino-7-methylthieno[2,3-b]quinolin-2-yl)-(2-methyl-2,3-dihydroindol-1-yl)methanone
SMILESCc1ccc2cc3c(N)c(C(=O)N4c5ccccc5CC4C)sc3nc2c1
InChIInChI=1S/C22H19N3OS/c1-12-7-8-14-11-16-19(23)20(27-21(16)24-17(14)9-12)22(26)25-13(2)10-15-5-3-4-6-18(15)25/h3-9,11,13H,10,23H2,1-2H3
InChIKeyLIMHQWLVCZLYRD-UHFFFAOYSA-N
XLogP4.93
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.48
LogP ≤ 54.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (3-amino-7-methylthieno[2,3-b]quinolin-2-yl)-(2-methyl-2,3-dihydroindol-1-yl)methanone with MolForge

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Related Compounds

(2,4-dimethyl-1,3-thiazol-5-yl)-(2-methyl-2,3-dihydroindol-1-yl)methanone
CID 42905966
(3,5-dimethyl-1H-indol-2-yl)-(2-methyl-2,3-dihydroindol-1-yl)methanone
CID 84578405
(4-amino-5-methylthiophen-2-yl)-(2-methyl-2,3-dihydroindol-1-yl)methanone
CID 61091919
(2-methyl-2,3-dihydroindol-1-yl)-(2-methyl-1,3-thiazol-5-yl)methanone
CID 110863850
(2-iodo-4-methylphenyl)-[(2R)-2-methyl-2,3-dihydroindol-1-yl]methanone
CID 100527033
N-[4-methyl-5-[(2S)-2-methyl-2,3-dihydroindole-1-carbonyl]-1,3-thiazol-2-yl]methanesulfonamide
CID 100772751
[(2R)-2-methyl-2,3-dihydroindol-1-yl]-(4-methyl-2-pyridin-3-yl-1,3-thiazol-5-yl)methanone
CID 39080777
(2-methyl-2,3-dihydroindol-1-yl)-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)methanone
CID 46533643
[5-(2,5-dimethylanilino)pyrazin-2-yl]-(2-methyl-2,3-dihydroindol-1-yl)methanone
CID 109290952
[(2S)-2-methyl-2,3-dihydroindol-1-yl]-(5-methylpyrazin-2-yl)methanone
CID 93240954
1H-indazol-6-yl-(2-methyl-2,3-dihydroindol-1-yl)methanone
CID 60719171
(2-methyl-2,3-dihydroindol-1-yl)-phenylmethanone
CID 15274130

Frequently Asked Questions

What is the IUPAC name of (3-amino-7-methylthieno[2,3-b]quinolin-2-yl)-(2-methyl-2,3-dihydroindol-1-yl)methanone?
The IUPAC name of (3-amino-7-methylthieno[2,3-b]quinolin-2-yl)-(2-methyl-2,3-dihydroindol-1-yl)methanone (CID 3207319) is (3-amino-7-methylthieno[2,3-b]quinolin-2-yl)-(2-methyl-2,3-dihydroindol-1-yl)methanone.
What is the SMILES notation for (3-amino-7-methylthieno[2,3-b]quinolin-2-yl)-(2-methyl-2,3-dihydroindol-1-yl)methanone?
The canonical SMILES for (3-amino-7-methylthieno[2,3-b]quinolin-2-yl)-(2-methyl-2,3-dihydroindol-1-yl)methanone is Cc1ccc2cc3c(N)c(C(=O)N4c5ccccc5CC4C)sc3nc2c1.
What is the InChIKey of (3-amino-7-methylthieno[2,3-b]quinolin-2-yl)-(2-methyl-2,3-dihydroindol-1-yl)methanone?
The InChIKey is LIMHQWLVCZLYRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N3OS/c1-12-7-8-14-11-16-19(23)20(27-21(16)24-17(14)9-12)22(26)25-13(2)10-15-5-3-4-6-18(15)25/h3-9,11,13H,10,23H2,1-2H3.
What are the key properties of (3-amino-7-methylthieno[2,3-b]quinolin-2-yl)-(2-methyl-2,3-dihydroindol-1-yl)methanone?
(3-amino-7-methylthieno[2,3-b]quinolin-2-yl)-(2-methyl-2,3-dihydroindol-1-yl)methanone has a molecular weight of 373.48 g/mol, XLogP of 4.93, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-amino-7-methylthieno[2,3-b]quinolin-2-yl)-(2-methyl-2,3-dihydroindol-1-yl)methanone is sourced from PubChem (CID 3207319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).